Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.33 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30595364 | 0.85 | CYP4F2 (0.40) | IDO1ERCC1ERCC4CYP3A4TSHR | |
| SCHEMBL2008856 | 0.85 | CYP4F2 (0.40) | IDO1ERCC1ERCC4CYP3A4TSHR | |
| SCHEMBL522987 | 0.85 | RECQL (0.43) | RECQLNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL7164454 | 0.83 | CYP4F2 (0.40) | NPC1RAB9ASMN1; SMN2HPGDIDO1 | |
| SCHEMBL18982153 | 0.83 | RECQL (0.39) | RECQLNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL30442346 | 0.83 | CYP4F2 (0.40) | NPC1RAB9ASMN1; SMN2HPGDIDO1 | |
| SCHEMBL12900227 | 0.79 | RECQL (0.39) | RECQLNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL15778552 | 0.79 | LMNA (0.43) | RECQLNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL15833206 | 0.79 | IDO1 (0.34) | IDO1ERCC1ERCC4CYP3A4TSHR | |
| SCHEMBL15516408 | 0.76 | L3MBTL1 (0.33) | IDO1ERCC1ERCC4CYP3A4TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118359546-A | Nitric oxide donor type ambrisentan derivative, and pharmaceutical composition and application thereof | 江苏海洋大学 | 2024-07-19 | — | — | CN | disclosed |
| CN-118359595-A | Nitric oxide donor type atrasentan derivative, and pharmaceutical composition and application thereof | 江苏海洋大学 | 2024-07-19 | — | — | CN | disclosed |